3-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]sulfanyl-1,3,4,5-tetrahydro-1-benzazepin-2-one

Systemtic Name: 3-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]sulfanyl-1,3,4,5-tetrahydro-1-benzazepin-2-one Openeye Name: 3-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-1,3,4,5-tetrahydro-1-benzazepin-2-one CAS Name: 3-[[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one IUPAC Name: 3-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]sulfanyl-1,3,4,5-tetrahydro-1-benzazepin-2-one Traditional Name: 3-[[2-(4-benzylpiperidino)-2-keto-ethyl]thio]-1,3,4,5-tetrahydro-1-benzazepin-2-one Formula: C24H28N2O2S MolecularWeight: 408.55632

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2NC(=O)C1SCC(=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CC2=CC=CC=C2NC(=O)C1SCC(=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H28N2O2S/c27-23(26-14-12-19(13-15-26)16-18-6-2-1-3-7-18)17-29-22-11-10-20-8-4-5-9-21(20)25-24(22)28/h1-9,19,22H,10-17H2,(H,25,28)